sodium;hydride;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid;stibane

C6H16NaO7Sb — CID 173024779

IUPACsodium;hydride;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid;stibane
SMILESO=C(O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.[H-].[Na+].[SbH3]
InChIInChI=1S/C6H12O7.Na.Sb.4H/c7-1-2(8)3(9)4(10)5(11)6(12)13;;;;;;/h2-5,7-11H,1H2,(H,12,13);;;;;;/q;+1;;;;;-1/t2-,3-,4+,5-;;;;;;/m1....../s1
InChIKeyROMOBRZSXSZWHC-GVLOCLSNSA-N
MW344.94 g/mol
LogP-7.56
Rot. Bonds5

About sodium;hydride;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid;stibane

sodium;hydride;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid;stibane (PubChem CID 173024779) has the molecular formula C6H16NaO7Sb and a molecular weight of 344.94 g/mol. Its IUPAC name is sodium;hydride;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid;stibane.

Molecular Properties

Compound Namesodium;hydride;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid;stibane
PubChem CID173024779
Molecular FormulaC6H16NaO7Sb
Molecular Weight344.94 g/mol
Exact Mass343.98
IUPAC Namesodium;hydride;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid;stibane
SMILESO=C(O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.[H-].[Na+].[SbH3]
InChIInChI=1S/C6H12O7.Na.Sb.4H/c7-1-2(8)3(9)4(10)5(11)6(12)13;;;;;;/h2-5,7-11H,1H2,(H,12,13);;;;;;/q;+1;;;;;-1/t2-,3-,4+,5-;;;;;;/m1....../s1
InChIKeyROMOBRZSXSZWHC-GVLOCLSNSA-N
XLogP-7.56
TPSA138.45 Ų
H-Bond Donors6
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.94
LogP ≤ 5-7.56
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

potassium;hydride;tris((2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid)
CID 173213444
(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxy(113C)hexanoic acid
CID 165412478
hexane-1,2,3,4,5,6-hexol;2,3,4,5,6-pentahydroxyhexanoic acid
CID 174726112
(4R)-2,3,4,5,6-pentahydroxyhexanoic acid
CID 134944021
(3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid
CID 11479470
sodium;(2R,3S,4R,5R)-2,3,4,5,6,7-hexahydroxyheptanoic acid;hydride;iron;hydrochloride
CID 173361830
magnesium;hydride;λ2-stannane;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid
CID 173075138
azane;bis((2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid)
CID 175905684
2,3,4,5,6-pentahydroxyhexanoic acid;samarium
CID 174356569
pentacosazinc;tridecakis((2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid)
CID 173246066
(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid;(2S,4R)-pentane-1,2,3,4,5-pentol
CID 175899129
copper;bis((2R,3R,4S,5R)-2,3,4,5,6-pentahydroxyhexanoic acid)
CID 14475284

Frequently Asked Questions

What is the IUPAC name of sodium;hydride;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid;stibane?
The IUPAC name of sodium;hydride;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid;stibane (CID 173024779) is sodium;hydride;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid;stibane.
What is the SMILES notation for sodium;hydride;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid;stibane?
The canonical SMILES for sodium;hydride;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid;stibane is O=C(O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.[H-].[Na+].[SbH3].
What is the InChIKey of sodium;hydride;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid;stibane?
The InChIKey is ROMOBRZSXSZWHC-GVLOCLSNSA-N. The full InChI is InChI=1S/C6H12O7.Na.Sb.4H/c7-1-2(8)3(9)4(10)5(11)6(12)13;;;;;;/h2-5,7-11H,1H2,(H,12,13);;;;;;/q;+1;;;;;-1/t2-,3-,4+,5-;;;;;;/m1....../s1.
What are the key properties of sodium;hydride;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid;stibane?
sodium;hydride;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid;stibane has a molecular weight of 344.94 g/mol, XLogP of -7.56, 5 rotatable bonds, 6 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;hydride;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid;stibane is sourced from PubChem (CID 173024779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).